Author results

5ZB5
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THE STRUCTURAL BASIS OF HISTONE CHAPERONEVPS75
Descriptor:NAP family histone chaperone vps75, DI(HYDROXYETHYL)ETHER, GLYCEROL
Authors:Chen, Y., Yang, Z., Dou, Y., Deren, L., Meilin, W., Sidan, X., Hua, J., Huiyan, L.
Deposit date:2018-02-09
Release date:2019-02-13
Method:X-RAY DIFFRACTION (2.299 Å)
Cite:The structural basis of histone chaperone Vps75
To Be Published
6IAM
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MODULATING PROTEIN-PROTEIN INTERACTIONS WITH VISIBLE LIGHT PEPTIDE BACKBONE SWITCHES
Descriptor:WD repeat-containing protein 5, SER-ALA-ARG-ALA-XY5-VAL-HIS-LEU-ARG-LYS-SER-ALA, Small ubiquitin-related modifier 5, ...
Authors:Werel, L., Essen, L.-O.
Deposit date:2018-11-27
Release date:2019-02-06
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:Modulating Protein-Protein Interactions with Visible-Light Responsive Peptide Backbone Photoswitches.
Chembiochem, 2019
5YYC
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CRYSTAL STRUCTURE OF ALANINE RACEMASE FROM BACILLUS PSEUDOFIRMUS (OF4)
Descriptor:Alanine racemase, PYRIDOXAL-5'-PHOSPHATE
Authors:Dong, H., Hu, T.T., He, G.Z., Lu, D.R., Qi, J.X., Dou, Y.S., Long, W., He, X., Su, D., Ju, J.S.
Deposit date:2017-12-08
Release date:2019-01-02
Method:X-RAY DIFFRACTION (1.801 Å)
Cite:Structural features and kinetic characterization of alanine racemase from Bacillus pseudofirmus OF4.
Biochem. Biophys. Res. Commun., 497, 2018
6BYN
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CRYSTAL STRUCTURE OF WDR5-MB(S4) MONOBODY COMPLEX
Descriptor:WD repeat-containing protein 5, WDR5-binding Monobody, Mb(S4)
Authors:Gupta, A., Koide, S.
Deposit date:2017-12-21
Release date:2018-07-04
Last modified:2018-11-21
Method:X-RAY DIFFRACTION (2.69 Å)
Cite:Facile target validation in an animal model with intracellularly expressed monobodies.
Nat. Chem. Biol., 14, 2018
5XM2
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HUMAN N-TERMINAL DOMAIN OF FACT COMPLEX SUBUNIT SPT16
Descriptor:FACT complex subunit SPT16, GLYCEROL, DI(HYDROXYETHYL)ETHER
Authors:Xu, S., Li, H., Dou, Y., Chen, Y., Jiang, H., Lu, D., Wang, M., Su, D.
Deposit date:2017-05-12
Release date:2018-05-16
Method:X-RAY DIFFRACTION (2.187 Å)
Cite:The structure of hSPT16N terminus and its binding property with histone H3H4
To Be Published
6CKN
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CRYSTAL STRUCTURE OF AN AF10 FRAGMENT
Descriptor:Protein AF-10, UNKNOWN ATOM OR ION
Authors:Qin, S., Tempel, W., Li, Y., Bountra, C., Arrowsmith, C.H., Edwards, A.M., Min, J., Structural Genomics Consortium (SGC)
Deposit date:2018-02-28
Release date:2018-03-21
Last modified:2018-04-18
Method:X-RAY DIFFRACTION (2.49 Å)
Cite:Structural and functional analysis of the DOT1L-AF10 complex reveals mechanistic insights into MLL-AF10-associated leukemogenesis.
Genes Dev., 32, 2018
6CKO
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CRYSTAL STRUCTURE OF AN AF10 FRAGMENT
Descriptor:Protein AF-10, Histone-lysine N-methyltransferase, H3 lysine-79 specific, ...
Authors:Zhang, H., Tempel, W., Bountra, C., Arrowsmith, C.H., Edwards, A.M., Min, J., Structural Genomics Consortium (SGC)
Deposit date:2018-02-28
Release date:2018-03-21
Last modified:2018-04-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and functional analysis of the DOT1L-AF10 complex reveals mechanistic insights into MLL-AF10-associated leukemogenesis.
Genes Dev., 32, 2018
5M23
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MODULATION OF MLL1 METHYLTRANSFERASE ACTIVITY
Descriptor:WD repeat-containing protein 5, 4-[(~{E})-[4-[[[(2~{S})-2-[[(2~{S})-2-[[(2~{S})-2-[[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]amino]propanoyl]amino]-5-carbamimidamido-pentanoyl]amino]propanoyl]amino]methyl]phenyl]diazenyl]-~{N}-[(2~{S})-3-methyl-1-oxidanylidene-butan-2-yl]benzamide
Authors:Srinivasan, V.
Deposit date:2016-10-11
Release date:2017-06-28
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Controlled inhibition of methyltransferases using photoswitchable peptidomimetics: towards an epigenetic regulation of leukemia.
Chem Sci, 8, 2017
5M25
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MODULATION OF MLL1 METHYLTRANSFERASE ACTIVITY
Descriptor:WD repeat-containing protein 5, (2~{S})-2-[[(2~{S})-2-[[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]amino]propanoyl]amino]-5-carbamimidamido-~{N}-[(2~{S})-1-[[4-[(~{E})-[4-(hydroxymethyl)phenyl]diazenyl]phenyl]methylamino]-1-oxidanylidene-propan-2-yl]pentanamide
Authors:Srinivasan, V.
Deposit date:2016-10-11
Release date:2017-06-28
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Controlled inhibition of methyltransferases using photoswitchable peptidomimetics: towards an epigenetic regulation of leukemia.
Chem Sci, 8, 2017
5VFC
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WDR5 BOUND TO INHIBITOR MM-589
Descriptor:WD repeat-containing protein 5, N-{(3R,6S,9S,12R)-6-ethyl-12-methyl-9-[3-(N'-methylcarbamimidamido)propyl]-2,5,8,11-tetraoxo-3-phenyl-1,4,7,10-tetraazacyclotetradecan-12-yl}-2-methylpropanamide, SULFATE ION, ...
Authors:Stuckey, J.A.
Deposit date:2017-04-07
Release date:2017-06-28
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Discovery of a Highly Potent, Cell-Permeable Macrocyclic Peptidomimetic (MM-589) Targeting the WD Repeat Domain 5 Protein (WDR5)-Mixed Lineage Leukemia (MLL) Protein-Protein Interaction.
J. Med. Chem., 60, 2017
5C94
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INFECTIOUS BRONCHITIS VIRUS NSP9
Descriptor:Non-structural protein 9, DI(HYDROXYETHYL)ETHER, GLYCEROL
Authors:Chen, C., Dou, Y., Yang, H., Su, D.
Deposit date:2015-06-26
Release date:2016-06-29
Method:X-RAY DIFFRACTION (2.438 Å)
Cite:Crystal structure of nsp9 from infectious bronchitis virus (IBV) at 2.44 Angstroms resolution
To Be Published
5F59
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THE CRYSTAL STRUCTURE OF MLL3 SET DOMAIN
Descriptor:Histone-lysine N-methyltransferase 2C, ZINC ION, S-ADENOSYL-L-HOMOCYSTEINE
Authors:Li, Y., Lei, M., Chen, Y.
Deposit date:2015-12-04
Release date:2016-02-24
Last modified:2016-04-20
Method:X-RAY DIFFRACTION (2.801 Å)
Cite:Structural basis for activity regulation of MLL family methyltransferases.
Nature, 530, 2016
5F5E
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THE CRYSTAL STRUCTURE OF MLL1 SET DOMAIN WITH N3816I/Q3867L MUTATION
Descriptor:Histone-lysine N-methyltransferase 2A, ZINC ION, S-ADENOSYL-L-HOMOCYSTEINE
Authors:Li, Y., Lei, M., Chen, Y.
Deposit date:2015-12-04
Release date:2016-02-24
Last modified:2016-04-20
Method:X-RAY DIFFRACTION (1.802 Å)
Cite:Structural basis for activity regulation of MLL family methyltransferases.
Nature, 530, 2016
5F6K
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CRYSTAL STRUCTURE OF THE MLL3-ASH2L-RBBP5 COMPLEX
Descriptor:Set1/Ash2 histone methyltransferase complex subunit ASH2,Set1/Ash2 histone methyltransferase complex subunit ASH2, Histone-lysine N-methyltransferase 2C, Retinoblastoma-binding protein 5, ...
Authors:Li, Y., Lei, M., Chen, Y.
Deposit date:2015-12-06
Release date:2016-02-24
Last modified:2016-04-20
Method:X-RAY DIFFRACTION (2.411 Å)
Cite:Structural basis for activity regulation of MLL family methyltransferases.
Nature, 530, 2016
5F6L
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THE CRYSTAL STRUCTURE OF MLL1 (N3861I/Q3867L) IN COMPLEX WITH RBBP5 AND ASH2L
Descriptor:Retinoblastoma-binding protein 5, Set1/Ash2 histone methyltransferase complex subunit ASH2, Histone-lysine N-methyltransferase 2A, ...
Authors:Li, Y., Lei, M., Chen, Y.
Deposit date:2015-12-06
Release date:2016-02-24
Last modified:2016-04-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural basis for activity regulation of MLL family methyltransferases.
Nature, 530, 2016
4LX4
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CRYSTAL STRUCTURE DETERMINATION OF PSEUDOMONAS STUTZERI ENDOGLUCANASE CEL5A USING A TWINNED DATA SET
Descriptor:Endoglucanase(Endo-1,4-beta-glucanase)protein, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
Authors:Dutoit, R., Delsaute, M., Berlemont, R., Van Elder, D., Galleni, M., Bauvois, C.
Deposit date:2013-07-29
Release date:2014-07-30
Method:X-RAY DIFFRACTION (1.556 Å)
Cite:Structure of the Pseudomonas stutzeri beta-1,4 endoglucanase determined at 1.6 A resolution using a twinned crystal.
To be Published
4MZF
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CRYSTAL STRUCTURE OF HUMAN SPINDLIN1 BOUND TO HISTONE H3(K4ME3-R8ME2A) PEPTIDE
Descriptor:Peptide from Histone H3.2, Spindlin-1, CHLORIDE ION, ...
Authors:Su, X., Ding, X., Li, H.
Deposit date:2013-09-30
Release date:2014-03-26
Method:X-RAY DIFFRACTION (2.098 Å)
Cite:Molecular basis underlying histone H3 lysine-arginine methylation pattern readout by Spin/Ssty repeats of Spindlin1
Genes Dev., 28, 2014
4MZG
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CRYSTAL STRUCTURE OF HUMAN SPINDLIN1 BOUND TO HISTONE H3K4ME3 PEPTIDE
Descriptor:Peptide from Histone H3.2, Spindlin-1, (4R)-2-METHYLPENTANE-2,4-DIOL, ...
Authors:Su, X., Ding, X., Li, H.
Deposit date:2013-09-30
Release date:2014-03-26
Method:X-RAY DIFFRACTION (1.698 Å)
Cite:Molecular basis underlying histone H3 lysine-arginine methylation pattern readout by Spin/Ssty repeats of Spindlin1
Genes Dev., 28, 2014
4MZH
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CRYSTAL STRUCTURE OF HUMAN SPINDLIN1 BOUND TO HISTONE H3(K4ME3-R8ME2S) PEPTIDE
Descriptor:Spindlin-1, Peptide from Histone H3.2, MAGNESIUM ION
Authors:Su, X., Ding, X., Li, H.
Deposit date:2013-09-30
Release date:2014-03-26
Method:X-RAY DIFFRACTION (2.204 Å)
Cite:Molecular basis underlying histone H3 lysine-arginine methylation pattern readout by Spin/Ssty repeats of Spindlin1
Genes Dev., 28, 2014
4GM9
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CRYSTAL STRUCTURE OF HUMAN WD REPEAT DOMAIN 5 WITH COMPOUND MM-401
Descriptor:WD repeat-containing protein 5, MM-401
Authors:Karatas, H., Townsend, E.C., Chen, Y., Bernard, D., Liu, L., Dou, Y., Lei, M., Wang, S.
Deposit date:2012-08-15
Release date:2014-02-19
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structure of human WD repeat domain 5 with compound MM-401
To be Published
4GMB
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CRYSTAL STRUCTURE OF HUMAN WD REPEAT DOMAIN 5 WITH COMPOUND MM-402
Descriptor:WD repeat-containing protein 5, MM-402
Authors:Karatas, H., Townsend, E.C., Chen, Y., Bernard, D., Cao, F., Liu, L., Lei, M., Dou, Y., Wang, S.
Deposit date:2012-08-15
Release date:2014-02-19
Last modified:2017-06-28
Method:X-RAY DIFFRACTION (2.781 Å)
Cite:Discovery of a Highly Potent, Cell-Permeable Macrocyclic Peptidomimetic (MM-589) Targeting the WD Repeat Domain 5 Protein (WDR5)-Mixed Lineage Leukemia (MLL) Protein-Protein Interaction.
J. Med. Chem., 2017
4GM3
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CRYSTAL STRUCTURE OF HUMAN WD REPEAT DOMAIN 5 WITH COMPOUND MM-101
Descriptor:WD repeat-containing protein 5, MM-101
Authors:Karatas, H., Townsend, E.C., Chen, Y., Bernard, D., Cao, F., Liu, L., Lei, M., Dou, Y., Wang, S.
Deposit date:2012-08-15
Release date:2013-07-31
Method:X-RAY DIFFRACTION (3.393 Å)
Cite:High-affinity, small-molecule peptidomimetic inhibitors of MLL1/WDR5 protein-protein interaction.
J.Am.Chem.Soc., 135, 2013
4GM8
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CRYSTAL STRUCTURE OF HUMAN WD REPEAT DOMAIN 5 WITH COMPOUND MM-102
Descriptor:WD repeat-containing protein 5, MM-102
Authors:Karatas, H., Townsend, E.C., Chen, Y., Bernard, D., Cao, F., Liu, L., Lei, M., Dou, Y., Wang, S.
Deposit date:2012-08-15
Release date:2013-07-31
Method:X-RAY DIFFRACTION (2.601 Å)
Cite:High-affinity, small-molecule peptidomimetic inhibitors of MLL1/WDR5 protein-protein interaction.
J.Am.Chem.Soc., 135, 2013
4DNC
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CRYSTAL STRUCTURE OF HUMAN MOF IN COMPLEX WITH MSL1
Descriptor:Histone acetyltransferase KAT8, Male-specific lethal 1 homolog, ZINC ION
Authors:Huang, J., Lei, M.
Deposit date:2012-02-08
Release date:2012-07-25
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structural insight into the regulation of MOF in the male-specific lethal complex and the non-specific lethal complex.
Cell Res., 22, 2012
3TOJ
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STRUCTURE OF THE SPRY DOMAIN OF HUMAN ASH2L
Descriptor:Set1/Ash2 histone methyltransferase complex subunit ASH2
Authors:Chen, Y., Cao, F., Wan, B., Dou, Y., Lei, M.
Deposit date:2011-09-05
Release date:2012-01-25
Last modified:2017-08-23
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Structure of the SPRY domain of human Ash2L and its interactions with RbBP5 and DPY30.
Cell Res., 22, 2012
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